Vitas-M small molecule compound

(2S)-({[(3-benzyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}amino)(phenyl)ethanoic acid

Catalog ID
STL460833
SMILES O=C(N[C@@H](c1ccccc1)C(=O)O)COc1ccc2c(c1)oc(=O)c(c2C)Cc1ccccc1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C27H23NO6 MW 457.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23NO6/c1-17-21-13-12-20(15-23(21)34-27(32)22(17)14-18-8-4-2-5-9-18)33-16-24(29)28-25(26(30)31)19-10-6-3-7-11-19/h2-13,15,25H,14,16H2,1H3,(H,28,29)(H,30,31)/t25-/m0/s1
InChIKey
DVBYJMDAOLXRQB-VWLOTQADSA-N
Synonyms
956385-00-5
(2S)((((3benzyl4methyl2oxo2Hchromen7yl)oxy)acetyl)amino)(phenyl)ethanoicacid
(2S)2((2(3BENZYL4METHYL2OXOCHROMEN7YL)OXYACETYL)AMINO)2PHENYLACETICACID
(S)2(2((3benzyl4methyl2oxo2Hchromen7yl)oxy)acetamido)2phenylaceticacid
956385005
CC1=C(C(=O)OC2=C1C=CC(=C2)OCC(=O)NC(C3=CC=CC=C3)C(=O)O)CC4=CC=CC=C4
InChI=1SC27H23NO6c11721131220(1523(21)3427(32)22(17)14188425918)331624(29)2825(26(30)31)19106371119h2131525H1416H21H3(H2829)(H3031)t25m0s1
O=C(N(C@@H)(c1ccccc1)C(=O)O)COc1ccc2c(c1)oc(=O)c(c2C)Cc1ccccc1
ZINC000002091330
ZINC2091330

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Available files

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